6-Dehydro Prednisolone
TL;DR: 6-Dehydro Prednisolone (CAS 280571-77-9) is a chemical compound with molecular formula C21H26O5 and molecular weight 358.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one
Also Known As: 6-Dehydro Prednisolone, 6,7-Dehydro Prednisolone, delta6-Prednisolone, 6,7-Dehydroprednisolone, Prednisolone EP Impurity H
| Molecular Formula | C21H26O5 |
|---|---|
| Molecular Weight | 358.18 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.178 |
| Heavy Atoms | 26 |
| Complexity | 764.0 |
Chemical Identifiers
| CAS Number | 280571-77-9 |
|---|---|
| SMILES | C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)C=CC4=CC(=O)C=C[C@]34C)O |
| InChIKey | WFFSJFFZKKRVOE-VWUMJDOOSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Dehydro Prednisolone (CAS 280571-77-9), with molecular formula C21H26O5 and molecular weight 358.18 g/mol. IUPAC: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 6-Dehydro Prednisolone
Property Insights of 6-Dehydro Prednisolone
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Dehydro Prednisolone. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Dehydro Prednisolone. Following Lipinski's Rule of Five, 6-Dehydro Prednisolone has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Dehydro Prednisolone?
The CAS number of 6-Dehydro Prednisolone is 280571-77-9.
What is the molecular formula of 6-Dehydro Prednisolone?
The molecular formula of 6-Dehydro Prednisolone is C21H26O5.
What is the molecular weight of 6-Dehydro Prednisolone?
The molecular weight of 6-Dehydro Prednisolone is 358.18 g/mol.
Where can I buy 6-Dehydro Prednisolone?
You can request a quote for 6-Dehydro Prednisolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Dehydro Prednisolone?
Yes, KEHONG BIO provides custom synthesis services for 6-Dehydro Prednisolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.